194089-07-1
1-[2-(4-CHLOROPHENYL)ETHYL]-1,2,3,4-TETRAHYDRO-6-METHOXY-2-METHYL-7-ISOQUINOLINOL HYDROCHLORIDE
Name1-[2-(4-CHLOROPHENYL)ETHYL]-1,2,3,4-TETRAHYDRO-6-METHOXY-2-METHYL-7-ISOQUINOLINOL HYDROCHLORIDE
FormulaC19 H22 Cl N O2 . Cl H
1Identification
【Name】
1-[2-(4-CHLOROPHENYL)ETHYL]-1,2,3,4-TETRAHYDRO-6-METHOXY-2-METHYL-7-ISOQUINOLINOL HYDROCHLORIDE
【CAS】
【MDL】
MFCD01717050
【English Synonyms】
【Formula】
C19 H22 Cl N O2 . Cl H
【MolWeight】
368.302
【Inchi】
InChI=1S/C19H22ClNO2.ClH/c1-21-10-9-14-11-19(23-2)18(22)12-16(14)17(21)8-5-13-3-6-15(20)7-4-13;/h3-4,6-7,11-12,17,22H,5,8-10H2,1-2H3;1H
【InChIKey】
InChIKey=NVIPBLQAFKRFSZ-UHFFFAOYSA-N
【SMILES】
CN1CCc2cc(c(cc2C1CCc3ccc(cc3)Cl)O)OC.Cl
【MOL File】
1-[2-(4-CHLOROPHENYL….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:3
XLogP3:4.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
1-[2-(4-CHLOROPHENYL)ETHYL]-1,2,3,4-TETRAHYDRO-6-METHOXY-2-METHYL-7-ISOQUINOLINOL HYDROCHLORIDE.cml